N-(4-oxidanylidene-1H-quinazolin-6-yl)pyrrolidine-1-carbothioamide

Systemtic Name: N-(4-oxidanylidene-1H-quinazolin-6-yl)pyrrolidine-1-carbothioamide Openeye Name: N-(4-oxo-1H-quinazolin-6-yl)pyrrolidine-1-carbothioamide CAS Name: N-(4-oxo-1H-quinazolin-6-yl)-1-pyrrolidinecarbothioamide IUPAC Name: N-(4-oxo-1H-quinazolin-6-yl)pyrrolidine-1-carbothioamide Traditional Name: N-(4-keto-1H-quinazolin-6-yl)pyrrolidine-1-carbothioamide Formula: C13H14N4OS MolecularWeight: 274.34146

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=S)NC2=CC3=C(C=C2)NC=NC3=O

Isomeric SMILES

C1CCN(C1)C(=S)NC2=CC3=C(C=C2)NC=NC3=O

InChI

InChI=1S/C13H14N4OS/c18-12-10-7-9(3-4-11(10)14-8-15-12)16-13(19)17-5-1-2-6-17/h3-4,7-8H,1-2,5-6H2,(H,16,19)(H,14,15,18)